The Reactivity of Bispidine Ligand Based Iron( <scp>IV</scp> ) and Iron(V) Oxido Species for the Demethylation of Acetic Acid

. Reasons for the different reactivities have been explored by the WB index, EDA and an NBO analysis.

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Publication Details

Journal
Journal of Computational Chemistry
Published
2026-04-22
DOI
https://doi.org/10.1002/jcc.70369
Primary Topic
Metal-Catalyzed Oxygenation Mechanisms
Type
article
Field-Weighted Citation Impact
0.00

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article

The Reactivity of Bispidine Ligand Based Iron( IV ) and Iron(V) Oxido Species for the Demethylation of Acetic Acid

Gunasekaran Velmurugan, P COMBA
Journal of Computational Chemistry
Metal-Catalyzed Oxygenation Mechanisms
article

The Reactivity of Bispidine Ligand Based Iron( IV ) and Iron(V) Oxido Species for the Demethylation of Acetic Acid

Gunasekaran Velmurugan, P COMBA
article en

Abstract

. Reasons for the different reactivities have been explored by the WB index, EDA and an NBO analysis.

Journal of Computational ChemistryVol. 47(11)
National Institute of Technology Tiruchirappalli (IN), Heidelberg University (DE)
Deutsche Forschungsgemeinschaft, Bundesministerium für Bildung und Forschung
Life in Land
Openalex Percentile: Top 12%
Metal-Catalyzed Oxygenation Mechanisms
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